N-[4-bromanyl-2-[[(1-hexylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-2-[[(1-hexylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[4-bromo-2-[[(1-hexylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[4-bromo-2-[[(1-hexyl-2-benzimidazolyl)amino]methyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[4-bromo-2-[[(1-hexylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[4-bromo-2-[[(1-hexylbenzimidazol-2-yl)amino]methyl]phenyl]-4-methyl-benzenesulfonamide Formula: C27H31BrN4O2S MolecularWeight: 555.52964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Br)NS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2N=C1NCC3=C(C=CC(=C3)Br)NS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H31BrN4O2S/c1-3-4-5-8-17-32-26-10-7-6-9-25(26)30-27(32)29-19-21-18-22(28)13-16-24(21)31-35(33,34)23-14-11-20(2)12-15-23/h6-7,9-16,18,31H,3-5,8,17,19H2,1-2H3,(H,29,30)